Geometry & MOs

Info

ID:	440750
PubChem CID:	135231287
Reduced:	N2O4C23H34 (1)
Stoich.:	A2B4C23D34 (1)
Weight, g/mol:	420.161997
ΔH_f, kcal/mol:	-164.92
Dipole, Da:	4.05
IP(EA), eV:	-8.77(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(pyridin-4-ylmethyl)-3-[4-(1,2,3,4-tetrahydronaphthalen-1-ylsulfinamoyl)phenyl]urea

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2CC3(CCC4(CC3)OCCO4)N(C2O)CC5CCC5

DOS

IR

Vibrations