Geometry & MOs

Info

ID:	435654
PubChem CID:	135192076
Reduced:	FON3C12H12 (1)
Stoich.:	ABC3D12E12 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-29.08
Dipole, Da:	3.79
IP(EA), eV:	-9.64(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-C-[3-[formyl(methyl)amino]-4-propoxyphenyl]-N-(methylamino)carbonimidoyl] formate

Drug info:

PubChemData

Smile

CNC(=O)C1=NNC(=C1)CC2=CC=CC=C2F

DOS

IR

Vibrations