Geometry & MOs

Info

ID:	271993
PubChem CID:	103709158
Reduced:	BrOSN2C13H13 (1)
Stoich.:	ABCD2E13F13 (1)
Weight, g/mol:	200.061949
ΔH_f, kcal/mol:	8.44
Dipole, Da:	4.77
IP(EA), eV:	-9.66(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[(5-ethyl-1,3-thiazol-2-yl)methyl]carbamate

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations