Geometry & MOs

Info

ID:	218159
PubChem CID:	85088971
Reduced:	N3O7C21H29 (1)
Stoich.:	A3B7C21D29 (1)
Weight, g/mol:	434.23956
ΔH_f, kcal/mol:	-192.45
Dipole, Da:	3.8
IP(EA), eV:	-9.28(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1-bromooctadecyl)-1,3-dioxolan-4-yl]methanol

Drug info:

PubChemData

Smile

CCCCCC1C(=O)C2=C(C(C3(N2CC4C3N4C)O)COC(=O)N)C(=O)C15OCCO5

DOS

IR

Vibrations