Geometry & MOs

Info

ID:	433973
PubChem CID:	135174123
Reduced:	ON2C24H34 (1)
Stoich.:	AB2C24D34 (1)
Weight, g/mol:	482.05273
ΔH_f, kcal/mol:	-16.52
Dipole, Da:	3.0
IP(EA), eV:	-8.63(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[(E)-2-(2-bromo-4-chlorophenyl)ethenyl]-5-chlorophenoxy]-N-(pyrrolidin-3-ylmethyl)propan-1-amine

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCCCNCC3CCNCC3

DOS

IR

Vibrations