Geometry & MOs

Info

ID:	172286
PubChem CID:	75489534
Reduced:	N2O2C10H11 (2)
Stoich.:	A2B2C10D11 (2)
Weight, g/mol:	344.076553
ΔH_f, kcal/mol:	-117.67
Dipole, Da:	3.03
IP(EA), eV:	-8.81(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-propan-2-yl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2C(=O)[C@@H](NC2=O)CC(=O)NCCC3=CC=CC=N3

DOS

IR

Vibrations