Geometry & MOs

Info

ID:	371199
PubChem CID:	127344264
Reduced:	O2N5C19H31 (1)
Stoich.:	A2B5C19D31 (1)
Weight, g/mol:	375.263425
ΔH_f, kcal/mol:	-85.16
Dipole, Da:	2.27
IP(EA), eV:	-9.39(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-cyclohexylacetyl)amino]ethyl]-4-(2-methylpyrazol-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)NCCNC(=O)N2CCC(CC2)C3=CC=NN3

DOS

IR

Vibrations