Geometry & MOs

Info

ID:	373758
PubChem CID:	131319719
Reduced:	OSN3C10H13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	223.077933
ΔH_f, kcal/mol:	15.27
Dipole, Da:	6.12
IP(EA), eV:	-7.81(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(4-methyl-2-pyrrol-3-ylidene-3H-1,3-thiazol-5-yl)ethanol

Drug info:

PubChemData

Smile

CC1=C(SC(=C2C=CC=N2)N1)C(CO)N

DOS

IR

Vibrations