Geometry & MOs

Info

ID:	134944
PubChem CID:	51787386
Reduced:	ClN2O3C25H27 (1)
Stoich.:	AB2C3D25E27 (1)
Weight, g/mol:	386.13972
ΔH_f, kcal/mol:	-72.36
Dipole, Da:	4.58
IP(EA), eV:	-9.25(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-chloro-N-formylanilino)-N-cyclohexyl-2-(2-hydroxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H](C1=C(C=C(C=C1)C)C)N(C2=CC=CC=C2Cl)C(=O)C3=CC=CO3

DOS

IR

Vibrations