Geometry & MOs

Info

ID:	57637
PubChem CID:	22428884
Reduced:	OSCl2N3C21H21 (1)
Stoich.:	ABC2D3E21F21 (1)
Weight, g/mol:	465.208613
ΔH_f, kcal/mol:	9.6
Dipole, Da:	3.21
IP(EA), eV:	-8.57(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(3,5-dimethoxyphenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-3-yl]sulfanyl]-N-(3,4-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(N=C2C3=CC(=C(C=C3)Cl)Cl)(C)C)C

DOS

IR

Vibrations