Geometry & MOs

Info

ID:	148051
PubChem CID:	53787713
Reduced:	CH2 (12)
Stoich.:	AB2 (12)
Weight, g/mol:	414.136176
ΔH_f, kcal/mol:	-47.99
Dipole, Da:	0.02
IP(EA), eV:	-10.21(3.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[(2-acetamido-4-phenylsulfanylanilino)-(propanoylamino)methylidene]carbamate

Drug info:

PubChemData

Smile

CCCC1C(C(C1CCC)C)C

DOS

IR

Vibrations