Geometry & MOs

Info

ID:	389901
PubChem CID:	134995853
Reduced:	FH15C16 (1)
Stoich.:	AB15C16 (1)
Weight, g/mol:	247.14331
ΔH_f, kcal/mol:	0.29
Dipole, Da:	1.66
IP(EA), eV:	-9.23(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-[(E)-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yldiazenyl]aniline

Drug info:

PubChemData

Smile

C1C[C@@]([C@H]1C2=CC=CC=C2)(C3=CC=CC=C3)F

DOS

IR

Vibrations