Geometry & MOs

Info

ID:	75421
PubChem CID:	48423454
Reduced:	N2O6C21H24 (1)
Stoich.:	A2B6C21D24 (1)
Weight, g/mol:	367.189592
ΔH_f, kcal/mol:	-210.69
Dipole, Da:	3.95
IP(EA), eV:	-9.43(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-(4-pyrrolidin-1-ylanilino)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OC)C(=O)OC

DOS

IR

Vibrations