Geometry & MOs

Info

ID:	347409
PubChem CID:	127272258
Reduced:	O3N4C20H38 (1)
Stoich.:	A3B4C20D38 (1)
Weight, g/mol:	336.069927
ΔH_f, kcal/mol:	-160.78
Dipole, Da:	4.14
IP(EA), eV:	-8.83(1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-chlorothiophen-2-yl)ethyl]-3-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)NC(C)CN3CCOCC3

DOS

IR

Vibrations