Geometry & MOs

Info

ID:	164654
PubChem CID:	74432563
Reduced:	O2C7H11 (2)
Stoich.:	A2B7C11 (2)
Weight, g/mol:	361.165425
ΔH_f, kcal/mol:	-188.31
Dipole, Da:	2.15
IP(EA), eV:	-9.28(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-amino-2-[(4-hexoxyphenyl)methyl]-3-hydroxypropyl] dihydrogen phosphate

Drug info:

PubChemData

Smile

CC1(OC(C(=CCC(=O)OC(C)(C)C)O1)C=C)C

DOS

IR

Vibrations