Geometry & MOs

Info

ID:	25795
PubChem CID:	630901
Reduced:	ON2S2H18C19 (1)
Stoich.:	AB2C2D18E19 (1)
Weight, g/mol:	336.95052
ΔH_f, kcal/mol:	22.4
Dipole, Da:	2.15
IP(EA), eV:	-8.04(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-yl)-N-(4-bromo-2-chlorophenyl)methanimine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(C3=C2C(=NC4=CC=C(C=C4)O)SS3)(C)C

DOS

IR

Vibrations