Geometry & MOs

Info

ID:	74242
PubChem CID:	48421625
Reduced:	N2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	313.142641
ΔH_f, kcal/mol:	-45.29
Dipole, Da:	3.41
IP(EA), eV:	-9.78(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-(pyridin-4-ylmethylamino)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC=CC=N1)OCC2CC2

DOS

IR

Vibrations