Geometry & MOs

Info

ID:	371132
PubChem CID:	127342576
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	291.104148
ΔH_f, kcal/mol:	-104.86
Dipole, Da:	3.32
IP(EA), eV:	-9.32(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1-benzothiophen-3-yl)-3-(1-methyl-2-oxopyrrolidin-3-yl)urea

Drug info:

PubChemData

Smile

CCC1CCCN1C(=O)NC2CCN(C2=O)C

DOS

IR

Vibrations