Geometry & MOs

Info

ID:	357140
PubChem CID:	127293366
Reduced:	O2N3C13H15 (1)
Stoich.:	A2B3C13D15 (1)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-32.52
Dipole, Da:	2.9
IP(EA), eV:	-9.34(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[methyl(oxolan-3-yl)amino]-3-oxopropyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CN(C1CCOC1)C(=O)C2=CNC3=C2C=CC=N3

DOS

IR

Vibrations