Geometry & MOs

Info

ID:	269515
PubChem CID:	103617819
Reduced:	O3N4C10H12 (1)
Stoich.:	A3B4C10D12 (1)
Weight, g/mol:	377.9632
ΔH_f, kcal/mol:	-84.15
Dipole, Da:	6.87
IP(EA), eV:	-9.73(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-iodobenzoyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1C(=O)N)C(=O)C2=NNC(=O)C=C2

DOS

IR

Vibrations