Geometry & MOs

Info

ID:	364475
PubChem CID:	127315727
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	272.188863
ΔH_f, kcal/mol:	-106.04
Dipole, Da:	0.99
IP(EA), eV:	-8.8(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-4-yl-(4,7-dimethyl-1,4-diazepan-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)CN2CCCCCC2=O)C

DOS

IR

Vibrations