Geometry & MOs

Info

ID:	343594
PubChem CID:	127266770
Reduced:	O2N3C17H17 (1)
Stoich.:	A2B3C17D17 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-35.36
Dipole, Da:	4.76
IP(EA), eV:	-9.35(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyano-2-oxopyridin-1-yl)-N-cycloheptylacetamide

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)CN2C=C(C3=CC=CC=C3C2=O)C#N

DOS

IR

Vibrations