Geometry & MOs

Info

ID:	413820
PubChem CID:	135086770
Reduced:	NOC18H27 (1)
Stoich.:	ABC18D27 (1)
Weight, g/mol:	358.135114
ΔH_f, kcal/mol:	-46.36
Dipole, Da:	3.21
IP(EA), eV:	-9.79(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)sulfonyl-3-[(2S)-2-phenylpent-4-enyl]urea

Drug info:

PubChemData

Smile

CCCCCCCCC(=C)CNC(=O)C1=CC=CC=C1

DOS

IR

Vibrations