Geometry & MOs

Info

ID:	364422
PubChem CID:	127315661
Reduced:	ON4C12H20 (1)
Stoich.:	AB4C12D20 (1)
Weight, g/mol:	263.163377
ΔH_f, kcal/mol:	-13.57
Dipole, Da:	4.04
IP(EA), eV:	-8.68(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4,7-dimethyl-1,4-diazepane-1-carbonyl)-1-methylpyridin-2-one

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)C2=C(NN=C2)C)C

DOS

IR

Vibrations