Geometry & MOs

Info

ID:	440800
PubChem CID:	135231513
Reduced:	SO2F3N7C24H28 (1)
Stoich.:	AB2C3D7E24F28 (1)
Weight, g/mol:	235.14331
ΔH_f, kcal/mol:	-97.39
Dipole, Da:	3.22
IP(EA), eV:	-8.38(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[4-methoxy-2-(2-propan-2-yliminohydrazinyl)phenyl]methanimidamide

Drug info:

PubChemData

Smile

CC1=NC(NN1CC2=CC(=NC=C2)N3CCC(CC3)SC)C4N=C(NO4)C5=CC=C(C=C5)OC(F)(F)F

DOS

IR

Vibrations