Geometry & MOs

Info

ID:	363448
PubChem CID:	127311251
Reduced:	N3O3C20H35 (1)
Stoich.:	A3B3C20D35 (1)
Weight, g/mol:	388.247441
ΔH_f, kcal/mol:	-168.02
Dipole, Da:	2.1
IP(EA), eV:	-8.86(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]cyclohexyl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1(COCCN1CCNC(=O)C2CCCCC2C(=O)N3CCCC3)C

DOS

IR

Vibrations