Geometry & MOs

Info

ID:	364430
PubChem CID:	127315682
Reduced:	O2N3C16H29 (1)
Stoich.:	A2B3C16D29 (1)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-111.66
Dipole, Da:	2.22
IP(EA), eV:	-8.72(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4,7-dimethyl-1,4-diazepan-1-yl)-2-oxoethyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)CN2CCCCCCC2=O)C

DOS

IR

Vibrations