Geometry & MOs

Info

ID:	387910
PubChem CID:	134987371
Reduced:	N3O3C10H11 (1)
Stoich.:	A3B3C10D11 (1)
Weight, g/mol:	220.086446
ΔH_f, kcal/mol:	10.64
Dipole, Da:	7.72
IP(EA), eV:	-9.25(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 3-methylbut-1-ynyl phosphate

Drug info:

PubChemData

Smile

CC/C(=N/NC1=CC=C(C=C1)[N+](=O)[O-])/C=O

DOS

IR

Vibrations