Geometry & MOs

Info

ID:	285868
PubChem CID:	104134093
Reduced:	ClN2O3C15H23 (1)
Stoich.:	AB2C3D15E23 (1)
Weight, g/mol:	306.149891
ΔH_f, kcal/mol:	-115.97
Dipole, Da:	4.8
IP(EA), eV:	-9.61(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-(cyclohexen-1-yl)ethyl]-6-propan-2-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)N(CCOC)CCOC)Cl

DOS

IR

Vibrations