Geometry & MOs

Info

ID:	73371
PubChem CID:	48417545
Reduced:	O2N4H10C11 (1)
Stoich.:	A2B4C10D11 (1)
Weight, g/mol:	233.091275
ΔH_f, kcal/mol:	22.66
Dipole, Da:	6.3
IP(EA), eV:	-9.3(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-amino-4-cyanopyrazol-1-yl)-2-oxoethyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)N2C(=C(C=N2)C#N)N

DOS

IR

Vibrations