Geometry & MOs

Info

ID:	440751
PubChem CID:	135231288
Reduced:	SO2N4C23H24 (1)
Stoich.:	AB2C4D23E24 (1)
Weight, g/mol:	354.115047
ΔH_f, kcal/mol:	9.45
Dipole, Da:	4.18
IP(EA), eV:	-8.16(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(benzylamino)sulfanylphenyl]-3-(1,3-oxazol-5-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)NS(=O)C3=CC=C(C=C3)NC(=O)NCC4=CC=NC=C4

DOS

IR

Vibrations