Geometry & MOs

Info

ID:	379744
PubChem CID:	134463696
Reduced:	N4O5H12C15 (1)
Stoich.:	A4B5C12D15 (1)
Weight, g/mol:	151.1361
ΔH_f, kcal/mol:	-8.57
Dipole, Da:	6.21
IP(EA), eV:	-9.17(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dimethyl-2,3,4,5,6,7-hexahydrocyclopenta[b]pyridine

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)[N+](=O)[O-])C(=O)/C(=C/2\C=NC=CN2)/C#N

DOS

IR

Vibrations