Geometry & MOs

Info

ID:	75138
PubChem CID:	48423076
Reduced:	ON2C8H13 (2)
Stoich.:	AB2C8D13 (2)
Weight, g/mol:	379.16444
ΔH_f, kcal/mol:	-46.98
Dipole, Da:	3.4
IP(EA), eV:	-9.63(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C1=NN=C2N1CCCCC2)NC(=O)C(C)OCC3CC3

DOS

IR

Vibrations