Geometry & MOs

Info

ID:	310872
PubChem CID:	126588317
Reduced:	FN2O3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	348.164934
ΔH_f, kcal/mol:	-105.46
Dipole, Da:	4.18
IP(EA), eV:	-8.94(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(difluoromethyl)-2-[(4-ethyl-2-methylphenoxy)methyl]phenyl]-3-methylurea

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=C(C=C2)F)N(C(=O)NC)O)C

DOS

IR

Vibrations