Geometry & MOs

Info

ID:	225913
PubChem CID:	87246417
Reduced:	PO4C32H33 (1)
Stoich.:	AB4C32D33 (1)
Weight, g/mol:	212.188863
ΔH_f, kcal/mol:	-95.65
Dipole, Da:	2.69
IP(EA), eV:	-9.11(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl(prop-2-enyl)azanium;2-methyl-N-propylprop-2-enimidate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1C2=CC=CC=C2)C)C(=O)P=O)C)C3=CC=CC=C3.CC(C)(C(=O)C1=CC=CC=C1)O

DOS

IR

Vibrations