Geometry & MOs

Info

ID:	379269
PubChem CID:	134356971
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	447.22704
ΔH_f, kcal/mol:	-162.37
Dipole, Da:	2.85
IP(EA), eV:	-8.81(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-5-formyl-N-methyl-1-[2-[[5-methyl-6-(5-methylpyridin-3-yl)pyridin-3-yl]amino]-2-oxoethyl]-3,4-dihydro-2H-pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C/C=C(\C(=C/C(C)CC1=CC(=C(C=C1)O)CO)\CO)/O

DOS

IR

Vibrations