Geometry & MOs

Info

ID:	149101
PubChem CID:	53788773
Reduced:	NOC18H20 (2)
Stoich.:	ABC18D20 (2)
Weight, g/mol:	205.085127
ΔH_f, kcal/mol:	-35.08
Dipole, Da:	8.05
IP(EA), eV:	-8.04(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1,2,4-oxadiazol-5-ylmethoxy)phenyl]methanamine

Drug info:

PubChemData

Smile

CCN1C(=C(C2=CC=CC=C21)CCCCC3(CC4=CC=CC=C4C(=O)O3)CC5=C(N(C6=CC=CC=C65)CC)C)C

DOS

IR

Vibrations