Geometry & MOs

Info

ID:	282250
PubChem CID:	103920123
Reduced:	NSO2C9H17 (1)
Stoich.:	ABC2D9E17 (1)
Weight, g/mol:	356.88568
ΔH_f, kcal/mol:	-112.57
Dipole, Da:	3.78
IP(EA), eV:	-8.71(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dibromo-N-[(2R)-1-hydroxybutan-2-yl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(=O)C1CCSC1

DOS

IR

Vibrations