Geometry & MOs

Info

ID:	140720
PubChem CID:	52746497
Reduced:	N2F3O4C20H21 (1)
Stoich.:	A2B3C4D20E21 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-297.6
Dipole, Da:	1.96
IP(EA), eV:	-9.64(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-1-(4-methoxybutyl)-3-(3-methoxyphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NCC(=O)NC[C@H](COC2=CC=C(C=C2)C(F)(F)F)O

DOS

IR

Vibrations