Geometry & MOs

Info

ID:	429741
PubChem CID:	135169792
Reduced:	O2F3N4H9C12 (1)
Stoich.:	A2B3C4D9E12 (1)
Weight, g/mol:	242.174276
ΔH_f, kcal/mol:	-142.98
Dipole, Da:	6.91
IP(EA), eV:	-9.02(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenylimino-N-[[hydroxy-[(2-methylpropan-2-yl)oxy]methyl]amino]-N'-methylpropanimidamide

Drug info:

PubChemData

Smile

C1=CN2C(=CC=N2)C(=C1)N=C(/C(=C\N)/C(=O)O)C(F)(F)F

DOS

IR

Vibrations