Geometry & MOs

Info

ID:	154798
PubChem CID:	56314323
Reduced:	SO2N3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	381.122107
ΔH_f, kcal/mol:	13.78
Dipole, Da:	4.85
IP(EA), eV:	-9.2(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-phenylbutyl)-2-(thiophen-2-ylmethylsulfanyl)benzamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)CCC1=NC(=NO1)C2=CSC=C2)C3=CC=CC=C3

DOS

IR

Vibrations