Geometry & MOs

Info

ID:	271687
PubChem CID:	103688417
Reduced:	NOF4C11H13 (1)
Stoich.:	ABC4D11E13 (1)
Weight, g/mol:	304.92922
ΔH_f, kcal/mol:	-246.44
Dipole, Da:	6.53
IP(EA), eV:	-9.04(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CC(CCO)NC1=C(C=C(C=C1)C(F)(F)F)F

DOS

IR

Vibrations