Geometry & MOs

Info

ID:	167976
PubChem CID:	74907703
Reduced:	SN2O3C22H22 (1)
Stoich.:	AB2C3D22E22 (1)
Weight, g/mol:	448.968152
ΔH_f, kcal/mol:	-49.58
Dipole, Da:	3.06
IP(EA), eV:	-8.34(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-[(2,4-dichlorophenyl)methylideneamino]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=C1)N(C(=NC(=O)C3=COC4CCCCC4C3=O)S2)CC#C)C

DOS

IR

Vibrations