Geometry & MOs

Info

ID:	253729
PubChem CID:	103120254
Reduced:	N3O3C13H17 (1)
Stoich.:	A3B3C13D17 (1)
Weight, g/mol:	183.100777
ΔH_f, kcal/mol:	-88.37
Dipole, Da:	7.83
IP(EA), eV:	-9.09(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-hydroxypropan-2-yl]-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=NN(C2=CC=CC=C21)C)(CO)O

DOS

IR

Vibrations