Geometry & MOs

Info

ID:	355134
PubChem CID:	127288066
Reduced:	ON6C16H22 (1)
Stoich.:	AB6C16D22 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	39.27
Dipole, Da:	4.94
IP(EA), eV:	-8.95(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-N-(1-ethylpiperidin-4-yl)-N-methyl-1,3-dioxoisoindole-5-carboxamide

Drug info:

PubChemData

Smile

CCN1CCC(CC1)N(C)C(=O)C2=CN=C(C=C2)N3C=NC=N3

DOS

IR

Vibrations