Geometry & MOs

Info

ID:	74404
PubChem CID:	48421823
Reduced:	SN2O3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	322.189257
ΔH_f, kcal/mol:	-92.65
Dipole, Da:	3.36
IP(EA), eV:	-9.07(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-(3-propan-2-yloxypropylamino)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCCC2=CC=CS2

DOS

IR

Vibrations