Geometry & MOs

Info

ID:	58758
PubChem CID:	24714828
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	331.262363
ΔH_f, kcal/mol:	-60.03
Dipole, Da:	6.46
IP(EA), eV:	-9.09(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)methyl]-N-(2-piperazin-1-ylethyl)cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CCN(CC)C1=C(C(=NO1)C2=CC=CC=C2)CN(CCOC)C(=O)C

DOS

IR

Vibrations