Geometry & MOs

Info

ID:	175044
PubChem CID:	75849941
Reduced:	NSO3C21H29 (1)
Stoich.:	ABC3D21E29 (1)
Weight, g/mol:	348.164934
ΔH_f, kcal/mol:	-107.56
Dipole, Da:	5.04
IP(EA), eV:	-9.0(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2,6-difluorophenyl)propan-2-yl]-3-[2-(4-methoxyphenyl)ethyl]urea

Drug info:

PubChemData

Smile

CCOCCOC(C)C(=O)NC(C1=CC=C(C=C1)C(C)C)C2=CC=CS2

DOS

IR

Vibrations