Geometry & MOs

Info

ID:	172516
PubChem CID:	75519562
Reduced:	SN3O4C13H13 (1)
Stoich.:	AB3C4D13E13 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-20.93
Dipole, Da:	5.54
IP(EA), eV:	-9.12(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-diphenyl-3-(1-propanoylpyrrolidin-3-yl)urea

Drug info:

PubChemData

Smile

CN(CC1=NC=CS1)C2=C(C=CC(=C2)C(=O)OC)[N+](=O)[O-]

DOS

IR

Vibrations