Geometry & MOs

Info

ID:	186220
PubChem CID:	77405452
Reduced:	ON2C25H34 (1)
Stoich.:	AB2C25D34 (1)
Weight, g/mol:	383.237978
ΔH_f, kcal/mol:	-32.45
Dipole, Da:	2.42
IP(EA), eV:	-9.47(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(2,16-dimethyl-15-tetracyclo[9.7.0.02,8.012,16]octadec-14-enyl)pyridine

Drug info:

PubChemData

Smile

CC12CCCC(=O)NCC1CCC3C2CCC4(C3CC=C4C5=CN=CC=C5)C

DOS

IR

Vibrations