Geometry & MOs

Info

ID:	183365
PubChem CID:	77012457
Reduced:	ClO2N4C14H19 (1)
Stoich.:	AB2C4D14E19 (1)
Weight, g/mol:	294.180424
ΔH_f, kcal/mol:	-27.66
Dipole, Da:	3.57
IP(EA), eV:	-8.98(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1,5-dimethylpyrazole-4-carbonyl)piperazin-1-yl]-N'-hydroxypropanimidamide

Drug info:

PubChemData

Smile

CC(C(=NO)N)N1CCN(CC1)C(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations