Geometry & MOs

Info

ID:	189816
PubChem CID:	77907924
Reduced:	O2N7C21H29 (1)
Stoich.:	A2B7C21D29 (1)
Weight, g/mol:	496.327739
ΔH_f, kcal/mol:	58.61
Dipole, Da:	2.02
IP(EA), eV:	-8.6(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-formamido-3,4-dihydroxyheptadecyl) 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

CC1(OC2C3CC3C(C2O1)N4C=NC5=C(N=C(N=C54)NN)NC(C6CC6)C7CC7)C

DOS

IR

Vibrations