Geometry & MOs

Info

ID:	353022
PubChem CID:	127284172
Reduced:	O3N4C21H28 (1)
Stoich.:	A3B4C21D28 (1)
Weight, g/mol:	379.156577
ΔH_f, kcal/mol:	-82.8
Dipole, Da:	7.63
IP(EA), eV:	-9.14(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-1-yl-(4-morpholin-4-ylsulfonylpiperazin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=CC4=C(O3)C=CC(=N4)C

DOS

IR

Vibrations