Geometry & MOs

Info

ID:	374739
PubChem CID:	131342577
Reduced:	FN2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	219.075625
ΔH_f, kcal/mol:	-35.08
Dipole, Da:	6.51
IP(EA), eV:	-9.32(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-formyl-4-(1-methylpyrazol-4-yl)-1H-imidazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCN[C@H](C1)C2=C(C(=CC=C2)[N+](=O)[O-])F

DOS

IR

Vibrations