Geometry & MOs

Info

ID:	175344
PubChem CID:	75885297
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	228.093249
ΔH_f, kcal/mol:	-42.73
Dipole, Da:	4.27
IP(EA), eV:	-9.37(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methoxypropan-2-yl)-3-(thiophen-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(COC)NC(=O)NCC1=CC(=CC=C1)CN2C=CN=C2

DOS

IR

Vibrations