Geometry & MOs

Info

ID:	149008
PubChem CID:	53788679
Reduced:	NSO4C10H19 (1)
Stoich.:	ABC4D10E19 (1)
Weight, g/mol:	395.166748
ΔH_f, kcal/mol:	-207.4
Dipole, Da:	5.45
IP(EA), eV:	-9.6(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[1-imidazol-1-yl-4-(4-methylsulfanylphenyl)butan-2-yl]oxyphenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)O)NC(=O)C(CO)CS

DOS

IR

Vibrations