Geometry & MOs

Info

ID:	75101
PubChem CID:	48422994
Reduced:	NO3C18H25 (1)
Stoich.:	AB3C18D25 (1)
Weight, g/mol:	379.16444
ΔH_f, kcal/mol:	-82.89
Dipole, Da:	4.28
IP(EA), eV:	-8.94(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[(6-pyrazol-1-ylpyridin-3-yl)methylamino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC(C1CC1)C2=CC=C(C=C2)OC)OCC3CC3

DOS

IR

Vibrations