Geometry & MOs

Info

ID:	397840
PubChem CID:	135030826
Reduced:	NC21H23 (1)
Stoich.:	AB21C23 (1)
Weight, g/mol:	304.121178
ΔH_f, kcal/mol:	33.91
Dipole, Da:	2.87
IP(EA), eV:	-8.9(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2-pyridin-2-ylphenyl)pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2=NC=CC3=C2C=CC(=C3)C(C)(C)C

DOS

IR

Vibrations