Geometry & MOs

Info

ID:	31812
PubChem CID:	3719547
Reduced:	FN3O4H20C24 (1)
Stoich.:	AB3C4D20E24 (1)
Weight, g/mol:	463.166269
ΔH_f, kcal/mol:	-88.12
Dipole, Da:	1.66
IP(EA), eV:	-8.46(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chlorophenyl)-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-[(4-methoxyphenyl)methyl]urea

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OC2=CN=C(N=C2C3=C(C=C(C=C3)OCC4=CC=C(C=C4)F)O)N

DOS

IR

Vibrations