Geometry & MOs

Info

ID:	21107
PubChem CID:	587216
Reduced:	N3O4C7H11 (1)
Stoich.:	A3B4C7D11 (1)
Weight, g/mol:	201.074956
ΔH_f, kcal/mol:	-133.29
Dipole, Da:	2.18
IP(EA), eV:	-9.28(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-5-(2-hydroxyethoxymethyl)-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C(COCC1=C(C(=NN1)C(=O)N)O)O

DOS

IR

Vibrations