Geometry & MOs

Info

ID:	203411
PubChem CID:	79827085
Reduced:	O3N4C14H16 (1)
Stoich.:	A3B4C14D16 (1)
Weight, g/mol:	305.14495
ΔH_f, kcal/mol:	-10.83
Dipole, Da:	8.66
IP(EA), eV:	-9.18(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butyl-1,3-thiazol-2-yl)-1-[2-(methoxymethyl)phenyl]ethanol

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)OC)NC2=NC(=C(C=C2)[N+](=O)[O-])N

DOS

IR

Vibrations