Geometry & MOs

Info

ID:	367050
PubChem CID:	127323033
Reduced:	O3N5C20H27 (1)
Stoich.:	A3B5C20D27 (1)
Weight, g/mol:	394.236876
ΔH_f, kcal/mol:	-108.64
Dipole, Da:	5.6
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6,6-trimethyl-2-[4-(1-pyridin-3-ylethyl)piperazine-1-carbonyl]-5,7-dihydro-1H-indol-4-one

Drug info:

PubChemData

Smile

CC(C1=CN=CC=C1)N2CCN(CC2)C(=O)C3CCC4(CC3)C(=O)NC(=O)N4

DOS

IR

Vibrations