Geometry & MOs

Info

ID:	142928
PubChem CID:	53117563
Reduced:	FSN2O4C21H25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	368.104003
ΔH_f, kcal/mol:	-175.93
Dipole, Da:	9.12
IP(EA), eV:	-9.44(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3-chlorophenyl)-3-oxopyrazin-2-yl]-3-[(4-methylphenyl)methyl]urea

Drug info:

PubChemData

Smile

CC1(CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)NCC3=CC(=CC=C3)F

DOS

IR

Vibrations