Geometry & MOs

Info

ID:	274114
PubChem CID:	103807136
Reduced:	ClION2C14H18 (1)
Stoich.:	ABCD2E14F18 (1)
Weight, g/mol:	262.204513
ΔH_f, kcal/mol:	-24.56
Dipole, Da:	4.05
IP(EA), eV:	-9.38(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(aminomethyl)-3-methylpiperidin-1-yl]-(3-tricyclo[3.2.1.02,4]octanyl)methanone

Drug info:

PubChemData

Smile

CC1CCCN(C1CN)C(=O)C2=C(C=CC(=C2)Cl)I

DOS

IR

Vibrations