Geometry & MOs

Info

ID:	282248
PubChem CID:	103920117
Reduced:	FN2O2C10H13 (1)
Stoich.:	AB2C2D10E13 (1)
Weight, g/mol:	201.057198
ΔH_f, kcal/mol:	-111.38
Dipole, Da:	3.7
IP(EA), eV:	-10.21(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-hydroxybutan-2-yl]thiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(=O)C1=CC(=NC=C1)F

DOS

IR

Vibrations