Geometry & MOs

Info

ID:	364408
PubChem CID:	127315647
Reduced:	ON3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-10.95
Dipole, Da:	5.76
IP(EA), eV:	-9.02(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4,7-dimethyl-1,4-diazepan-1-yl)-1-oxopropan-2-yl]acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations