Geometry & MOs

Info

ID:	441184
PubChem CID:	135233489
Reduced:	NC31H51 (1)
Stoich.:	AB31C51 (1)
Weight, g/mol:	457.341676
ΔH_f, kcal/mol:	-14.78
Dipole, Da:	2.22
IP(EA), eV:	-8.31(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[5-(2,2-dimethylpropylamino)-6-(methylamino)pyridin-2-yl]-2,2-dimethylcyclohexyl]-1-methyl-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC/C=C(\CCCCC(C)C(=C)C1=C(C=C(CC1=C)CCCC=CCNC)C)/CC(C)C

DOS

IR

Vibrations