Geometry & MOs

Info

ID:	191136
PubChem CID:	78109516
Reduced:	BrCl2O2N4H13C14 (1)
Stoich.:	AB2C2D4E13F14 (1)
Weight, g/mol:	612.595765
ΔH_f, kcal/mol:	-41.1
Dipole, Da:	3.38
IP(EA), eV:	-9.15(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-N-heptatriaconta-6,9,28,31-tetraen-19-ylacetamide

Drug info:

PubChemData

Smile

C1C(C(CO1)O)NC2=NC(=NC=C2Br)NC3=CC(=CC(=C3)Cl)Cl

DOS

IR

Vibrations