Geometry & MOs

Info

ID:	177790
PubChem CID:	76230497
Reduced:	SN4O4C18H22 (1)
Stoich.:	AB4C4D18E22 (1)
Weight, g/mol:	384.021452
ΔH_f, kcal/mol:	-76.19
Dipole, Da:	4.4
IP(EA), eV:	-8.52(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,3-dichlorophenyl)methylideneamino]-2-morpholin-4-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C=NNC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)O

DOS

IR

Vibrations