Geometry & MOs

Info

ID:	238674
PubChem CID:	92765024
Reduced:	ON3C12H17 (2)
Stoich.:	AB3C12D17 (2)
Weight, g/mol:	472.320212
ΔH_f, kcal/mol:	-33.34
Dipole, Da:	4.35
IP(EA), eV:	-8.6(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-2-(4-methylphenyl)-4-(4-methylpiperazin-1-yl)-3-(2,4,6-trimethylphenyl)imino-2-azaspiro[4.5]decan-1-one

Drug info:

PubChemData

Smile

CC1=NN2CCC(=O)N(C2=C1)[C@@H](C)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations