Geometry & MOs

Info

ID:	441196
PubChem CID:	135233531
Reduced:	NH21C32 (1)
Stoich.:	AB21C32 (1)
Weight, g/mol:	480.346427
ΔH_f, kcal/mol:	138.71
Dipole, Da:	2.41
IP(EA), eV:	-8.1(-0.82)
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]-3-(4-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C4=C3C=CC5=CC=CC=C54)C6=CC7=CC=CC=C7C=C6

DOS

IR

Vibrations