Geometry & MOs

Info

ID:	242982
PubChem CID:	99214748
Reduced:	ON2F3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	352.101227
ΔH_f, kcal/mol:	-170.11
Dipole, Da:	6.99
IP(EA), eV:	-9.37(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chlorothiophen-2-yl)methyl]-1-methyl-3-[(2S)-1-(2-methylphenoxy)propan-2-yl]urea

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1)C(=O)N[C@@H](C)C2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations