Geometry & MOs

Info

ID:	194855
PubChem CID:	78597568
Reduced:	FN3O4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	310.092912
ΔH_f, kcal/mol:	-112.53
Dipole, Da:	5.21
IP(EA), eV:	-8.14(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(difluoromethoxy)-3-methoxyphenyl]methylideneamino]-4-fluoroaniline

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=NNC2=CC=C(C=C2)F)OCC(=O)N3CCOCC3

DOS

IR

Vibrations