Geometry & MOs

Info

ID:	89366
PubChem CID:	49961022
Reduced:	N3O4C17H19 (1)
Stoich.:	A3B4C17D19 (1)
Weight, g/mol:	488.188212
ΔH_f, kcal/mol:	-127.02
Dipole, Da:	2.89
IP(EA), eV:	-9.85(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[(2,2-diphenylacetyl)carbamothioylamino]carbamoyl]phenyl]pentanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)NCC(=O)NN2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations