Geometry & MOs

Info

ID:	351368
PubChem CID:	127280256
Reduced:	O4N5C15H21 (1)
Stoich.:	A4B5C15D21 (1)
Weight, g/mol:	392.221226
ΔH_f, kcal/mol:	-116.56
Dipole, Da:	4.85
IP(EA), eV:	-9.22(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)CN3C(=O)CN(C3=O)C

DOS

IR

Vibrations