Geometry & MOs

Info

ID:	142895
PubChem CID:	53110655
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	324.183778
ΔH_f, kcal/mol:	-42.62
Dipole, Da:	7.14
IP(EA), eV:	-9.03(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cycloheptyl-5-(4-methoxyphenyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C1=CN=CC(=C1)C2=CC=C(C=C2)OC

DOS

IR

Vibrations