Geometry & MOs

Info

ID:	132228
PubChem CID:	51326071
Reduced:	N3O5C19H27 (1)
Stoich.:	A3B5C19D27 (1)
Weight, g/mol:	380.119464
ΔH_f, kcal/mol:	-203.54
Dipole, Da:	1.57
IP(EA), eV:	-8.91(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-[phenyl(thiophen-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OCO2)NC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

DOS

IR

Vibrations