Geometry & MOs

Info

ID:	364425
PubChem CID:	127315677
Reduced:	ON2C15H28 (1)
Stoich.:	AB2C15D28 (1)
Weight, g/mol:	238.204513
ΔH_f, kcal/mol:	-71.63
Dipole, Da:	4.41
IP(EA), eV:	-8.68(1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,7-dimethyl-1,4-diazepan-1-yl)-(1-methylcyclopentyl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)C2CCCCCC2)C

DOS

IR

Vibrations