Geometry & MOs

Info

ID:	238194
PubChem CID:	92729779
Reduced:	SN4O5C21H28 (1)
Stoich.:	AB4C5D21E28 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-202.5
Dipole, Da:	4.3
IP(EA), eV:	-9.42(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[5-[(4-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]phenyl]-3-[[(2S)-oxolan-2-yl]methyl]urea

Drug info:

PubChemData

Smile

C[C@H]1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCC4)C

DOS

IR

Vibrations