Geometry & MOs

Info

ID:	231229
PubChem CID:	87573080
Reduced:	N3O4C18H27 (1)
Stoich.:	A3B4C18D27 (1)
Weight, g/mol:	291.98811
ΔH_f, kcal/mol:	-184.11
Dipole, Da:	2.66
IP(EA), eV:	-9.13(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl N-(5-bromo-4-methyl-1,3-thiazol-2-yl)carbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(/C(=N/C(=O)OC(C)(C)C)/N)C(=O)OC(C)(C)C

DOS

IR

Vibrations