Geometry & MOs

Info

ID:	364459
PubChem CID:	127315711
Reduced:	ON2C17H24 (1)
Stoich.:	AB2C17D24 (1)
Weight, g/mol:	272.188863
ΔH_f, kcal/mol:	-32.71
Dipole, Da:	5.31
IP(EA), eV:	-8.71(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCN(CCN1C(=O)C2=CC3=C(CCC3)C=C2)C

DOS

IR

Vibrations