Geometry & MOs

Info

ID:	273919
PubChem CID:	103805854
Reduced:	IO2N3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-44.99
Dipole, Da:	5.85
IP(EA), eV:	-9.16(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)tricyclo[3.2.1.02,4]octane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)N(C)CC(=O)N2CCNCC2)I

DOS

IR

Vibrations