Geometry & MOs

Info

ID:	345780
PubChem CID:	127270080
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	-15.52
Dipole, Da:	2.88
IP(EA), eV:	-9.01(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclobutyl)-N-methylcycloheptanecarboxamide

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCCCCC4

DOS

IR

Vibrations