Geometry & MOs

Info

ID:	364486
PubChem CID:	127315738
Reduced:	OF2N2C14H18 (1)
Stoich.:	AB2C2D14E18 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-112.77
Dipole, Da:	5.96
IP(EA), eV:	-9.09(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopent-2-en-1-yl-1-(4,7-dimethyl-1,4-diazepan-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)C2=CC(=C(C=C2)F)F)C

DOS

IR

Vibrations