Geometry & MOs

Info

ID:	75643
PubChem CID:	48423781
Reduced:	SN2O2C17H22 (1)
Stoich.:	AB2C2D17E22 (1)
Weight, g/mol:	398.195405
ΔH_f, kcal/mol:	-31.0
Dipole, Da:	3.99
IP(EA), eV:	-9.15(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(6-morpholin-4-ylpyridin-3-yl)methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C(C)OCC3CC3

DOS

IR

Vibrations