Geometry & MOs

Info

ID:	258755
PubChem CID:	103156808
Reduced:	NO2C18H29 (1)
Stoich.:	AB2C18D29 (1)
Weight, g/mol:	267.169525
ΔH_f, kcal/mol:	-101.56
Dipole, Da:	3.51
IP(EA), eV:	-8.66(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-3-methoxybutanamide

Drug info:

PubChemData

Smile

CC(CC1=CC=C(C=C1)OCC(CC2CCCC2)O)NC

DOS

IR

Vibrations