Geometry & MOs

Info

ID:	437309
PubChem CID:	135222982
Reduced:	O3N4C15H18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	472.156912
ΔH_f, kcal/mol:	-91.53
Dipole, Da:	2.49
IP(EA), eV:	-9.28(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(4-phenylphenyl)methylsulfonylamino]phenyl]-3-(pyridin-4-ylmethyl)urea

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(C=C1)C)NC(=O)N.C1=CC=NC=C1

DOS

IR

Vibrations