Geometry & MOs

Info

ID:	233264
PubChem CID:	89449568
Reduced:	O3N4C8H8 (1)
Stoich.:	A3B4C8D8 (1)
Weight, g/mol:	226.025753
ΔH_f, kcal/mol:	48.49
Dipole, Da:	7.88
IP(EA), eV:	-9.65(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloropyrrolo[2,1-f][1,2,4]triazin-2-yl)methoxy methanimidate

Drug info:

PubChemData

Smile

C1=CN2C(=C1)C(=O)N=C(N2)COOC=N

DOS

IR

Vibrations