Geometry & MOs

Info

ID:	335612
PubChem CID:	127254474
Reduced:	N4O5C24H26 (1)
Stoich.:	A4B5C24D26 (1)
Weight, g/mol:	416.097683
ΔH_f, kcal/mol:	-55.21
Dipole, Da:	5.18
IP(EA), eV:	-8.17(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyphenyl)-4-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC2=NN3C(=CC=NC3=N2)C4=C(C(=C(C=C4)OC)OC)OC)OC

DOS

IR

Vibrations