Geometry & MOs

Info

ID:	440770
PubChem CID:	135231363
Reduced:	OSN4H12C14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	438.172562
ΔH_f, kcal/mol:	31.5
Dipole, Da:	4.65
IP(EA), eV:	-8.28(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[benzyl(propan-2-yl)sulfamoyl]phenyl]-3-(pyridin-4-ylmethyl)urea

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)NC3=CC=C(C=C3)NC(=O)N

DOS

IR

Vibrations