Geometry & MOs

Info

ID:	394775
PubChem CID:	135023757
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	322.168128
ΔH_f, kcal/mol:	-83.62
Dipole, Da:	2.65
IP(EA), eV:	-9.0(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[7-(4-methoxyphenyl)-2-bicyclo[2.2.1]heptanyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1([C@@H](N[C@@H]([C@@H]2C1=CC=C2)C3CCCCC3)C(=O)OC)C

DOS

IR

Vibrations