Geometry & MOs

Info

ID:	320702
PubChem CID:	126662717
Reduced:	OC18H18 (1)
Stoich.:	AB18C18 (1)
Weight, g/mol:	497.08122
ΔH_f, kcal/mol:	29.71
Dipole, Da:	2.18
IP(EA), eV:	-8.62(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-amino-3-[[3-[(4-chlorophenyl)carbamoyl]phenoxy]methyl]thieno[3,2-c]pyridin-7-yl] ethyl carbonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CCCOC=CC2=CC=CC=C2

DOS

IR

Vibrations