Geometry & MOs

Info

ID:	264204
PubChem CID:	103440807
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	260.188863
ΔH_f, kcal/mol:	-74.89
Dipole, Da:	3.4
IP(EA), eV:	-9.35(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(aminomethyl)-4-methylpiperidin-1-yl]-(3,5-dimethylphenyl)methanone

Drug info:

PubChemData

Smile

CC1CCN(C(C1)CN)C(=O)C2=CC(=CC=C2)O

DOS

IR

Vibrations