Geometry & MOs

Info

ID:	137502
PubChem CID:	52215375
Reduced:	ClN3O3C19H28 (1)
Stoich.:	AB3C3D19E28 (1)
Weight, g/mol:	373.182398
ΔH_f, kcal/mol:	-157.4
Dipole, Da:	4.0
IP(EA), eV:	-9.66(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-[(1R,2R)-2-methylcyclohexyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC(C)C)C(=O)[C@@H](C(C)C)NC(=O)C1=CC=C(C=C1)Cl

DOS

IR

Vibrations