Geometry & MOs

Info

ID:	310313
PubChem CID:	126578521
Reduced:	O2Cl14C31H42 (1)
Stoich.:	A2B14C31D42 (1)
Weight, g/mol:	469.39198
ΔH_f, kcal/mol:	-259.41
Dipole, Da:	12.96
IP(EA), eV:	-9.21(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[13-(4,4-dimethyl-2-phenylmethoxypentoxy)tridecyl]pyrrole

Drug info:

PubChemData

Smile

CC(C)C(C(C(C(C(C(C(C(C(C(C(C(C(C(OCC(CC(C)(C)C)OCC1=CC=CC=C1)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl

DOS

IR

Vibrations