Geometry & MOs

Info

ID:	135010
PubChem CID:	51796332
Reduced:	ClN3O3C24H34 (1)
Stoich.:	AB3C3D24E34 (1)
Weight, g/mol:	394.202321
ΔH_f, kcal/mol:	-142.5
Dipole, Da:	11.51
IP(EA), eV:	-9.57(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-butyl-2-(3-chloro-N-(2-methoxyacetyl)anilino)-2-cyclohexylacetamide

Drug info:

PubChemData

Smile

C/C=C\[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(C1=CC(=CC=C1)Cl)C(=O)[C@@H]2CCC(=O)N2

DOS

IR

Vibrations