Geometry & MOs

Info

ID:	203349
PubChem CID:	79816231
Reduced:	SO2N4C13H16 (1)
Stoich.:	AB2C4D13E16 (1)
Weight, g/mol:	266.18167
ΔH_f, kcal/mol:	16.31
Dipole, Da:	7.86
IP(EA), eV:	-9.22(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-2-[(2-methylazepan-2-yl)methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC1=CC=C(S1)CC(C)NC2=NC(=C(C=C2)[N+](=O)[O-])N

DOS

IR

Vibrations