Geometry & MOs

Info

ID:	58478
PubChem CID:	24702014
Reduced:	BrNOSH12C14 (1)
Stoich.:	ABCDE12F14 (1)
Weight, g/mol:	256.121178
ΔH_f, kcal/mol:	25.97
Dipole, Da:	6.2
IP(EA), eV:	-8.77(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-methoxyphenyl)methoxy]benzenecarboximidamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(=S)N)COC2=CC=C(C=C2)Br

DOS

IR

Vibrations