Geometry & MOs

Info

ID:	323920
PubChem CID:	126676598
Reduced:	O2N7C17H19 (1)
Stoich.:	A2B7C17D19 (1)
Weight, g/mol:	188.17763
ΔH_f, kcal/mol:	30.22
Dipole, Da:	4.64
IP(EA), eV:	-8.47(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-methoxyethoxy)octane

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C=C(C=N2)CC3=CC(=NC(=C3N)NN)N)C(=O)O

DOS

IR

Vibrations