Geometry & MOs

Info

ID:	185639
PubChem CID:	77324056
Reduced:	N2F3O3C23H25 (1)
Stoich.:	A2B3C3D23E25 (1)
Weight, g/mol:	364.9681
ΔH_f, kcal/mol:	-245.59
Dipole, Da:	5.18
IP(EA), eV:	-9.48(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrrolidin-3-yl N-[(5-bromo-2-oxo-3H-pyridin-3-yl)sulfonyl]carbamate

Drug info:

PubChemData

Smile

CC1C(NC2CC(CCC2C1=O)OC)C3=CN=CC(=C3)C4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations