Geometry & MOs

Info

ID:	137569
PubChem CID:	52228783
Reduced:	SO2N4C15H18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	410.141262
ΔH_f, kcal/mol:	-17.53
Dipole, Da:	4.39
IP(EA), eV:	-9.1(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]imidazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)CC(=O)N(C)C

DOS

IR

Vibrations