Geometry & MOs

Info

ID:	179250
PubChem CID:	76455657
Reduced:	SF3N4O7C29H33 (1)
Stoich.:	AB3C4D7E29F33 (1)
Weight, g/mol:	350.184172
ΔH_f, kcal/mol:	-352.51
Dipole, Da:	8.55
IP(EA), eV:	-9.35(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-[4-[3-(1-hydroxyethyl)-4-oxoazetidin-2-yl]-2-methyl-3-oxobut-1-enyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC1CCCN(CC1O)S(=O)(=O)C2=CC=CC=[N+]2[O-])NC(=O)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

DOS

IR

Vibrations