Geometry & MOs

Info

ID:	141220
PubChem CID:	52841206
Reduced:	SO2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	335.148121
ΔH_f, kcal/mol:	-12.02
Dipole, Da:	5.96
IP(EA), eV:	-9.08(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[(3,4,5-trimethoxyphenyl)methyl]urea

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)NC(=O)NCCSC2=CC=CC=C2

DOS

IR

Vibrations