Geometry & MOs

Info

ID:	175348
PubChem CID:	75885301
Reduced:	O2N5C14H19 (1)
Stoich.:	A2B5C14D19 (1)
Weight, g/mol:	329.140927
ΔH_f, kcal/mol:	-10.48
Dipole, Da:	4.61
IP(EA), eV:	-9.42(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methoxypropan-2-yl)-3-[2-[(4-methylphenyl)sulfonylamino]ethyl]urea

Drug info:

PubChemData

Smile

CC(COC)NC(=O)NCC1=C(N=CC=C1)N2C=CC=N2

DOS

IR

Vibrations