Geometry & MOs

Info

ID:	350820
PubChem CID:	127279108
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-132.08
Dipole, Da:	3.23
IP(EA), eV:	-8.68(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(CC1)N(CCN2C(=O)CNC2=O)CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations