Geometry & MOs

Info

ID:	440747
PubChem CID:	135231283
Reduced:	SO2N4H18C20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	364.135782
ΔH_f, kcal/mol:	43.97
Dipole, Da:	3.71
IP(EA), eV:	-8.56(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(benzylamino)sulfanylphenyl]-3-(pyridin-4-ylmethyl)urea

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2ON1SC3=CC=C(C=C3)NC(=O)NCC4=CC=NC=C4

DOS

IR

Vibrations