Geometry & MOs

Info

ID:	289621
PubChem CID:	104360802
Reduced:	ClOSN2C15H19 (1)
Stoich.:	ABCD2E15F19 (1)
Weight, g/mol:	365.96583
ΔH_f, kcal/mol:	-20.66
Dipole, Da:	7.83
IP(EA), eV:	-8.54(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methoxy]-3-chlorobenzaldehyde

Drug info:

PubChemData

Smile

C1CC(CN(C1)CC2=CC(=CC3=C2OCC3)Cl)C(=S)N

DOS

IR

Vibrations