Geometry & MOs

Info

ID:	274115
PubChem CID:	103807145
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	344.0291
ΔH_f, kcal/mol:	-34.58
Dipole, Da:	3.2
IP(EA), eV:	-9.19(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(aminomethyl)-3-methylpiperidin-1-yl]-(2-bromo-5-chlorophenyl)methanone

Drug info:

PubChemData

Smile

CC1CCCN(C1CN)C(=O)C2C3C2C4CCC3C4

DOS

IR

Vibrations