Geometry & MOs

Info

ID:	272667
PubChem CID:	103750813
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	310.08097
ΔH_f, kcal/mol:	-104.06
Dipole, Da:	2.51
IP(EA), eV:	-10.11(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxy-4-methylpentan-3-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC(CCO)C(C)C)[N+](=O)[O-]

DOS

IR

Vibrations