Geometry & MOs

Info

ID:	371057
PubChem CID:	127342249
Reduced:	SO4N6C15H26 (1)
Stoich.:	AB4C6D15E26 (1)
Weight, g/mol:	328.215078
ΔH_f, kcal/mol:	-114.67
Dipole, Da:	4.93
IP(EA), eV:	-9.48(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bicyclo[2.2.1]heptanyl)-3-[(2-phenyloxan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN2CCN(CC2)C(=O)NC3CCCN(C3)S(=O)(=O)C

DOS

IR

Vibrations