Geometry & MOs

Info

ID:	285072
PubChem CID:	104095631
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	185.116427
ΔH_f, kcal/mol:	-115.79
Dipole, Da:	3.38
IP(EA), eV:	-9.14(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(1-methoxyethyl)-1,2,4-oxadiazol-3-yl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C(=O)NC1C(C(C1(C)C)N)(C)C)OC

DOS

IR

Vibrations