Geometry & MOs

Info

ID:	433974
PubChem CID:	135174124
Reduced:	BrOCl2N2C22H25 (1)
Stoich.:	ABC2D2E22F25 (1)
Weight, g/mol:	364.110919
ΔH_f, kcal/mol:	-6.81
Dipole, Da:	0.31
IP(EA), eV:	-9.23(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(3,4-dichlorophenyl)methoxy]phenyl]methyl]-1-pyrrolidin-3-ylmethanamine

Drug info:

PubChemData

Smile

C1CNCC1CNCCCOC2=CC(=CC(=C2)/C=C/C3=C(C=C(C=C3)Cl)Br)Cl

DOS

IR

Vibrations