Geometry & MOs

Info

ID:	365365
PubChem CID:	127317764
Reduced:	NO2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-166.6
Dipole, Da:	2.83
IP(EA), eV:	-8.3(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-cyclopentyloxyphenyl)-3-[(3-methyloxolan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)NC2=CC=C(C=C2)OCC3CCCO3

DOS

IR

Vibrations