Geometry & MOs

Info

ID:	289067
PubChem CID:	104333521
Reduced:	BrClON2C14H18 (1)
Stoich.:	ABCD2E14F18 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-38.23
Dipole, Da:	4.02
IP(EA), eV:	-9.09(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(CCNCC1)CNC(=O)C2=C(C=C(C=C2)Br)Cl

DOS

IR

Vibrations