Geometry & MOs

Info

ID:	387436
PubChem CID:	134985361
Reduced:	PH26C27 (1)
Stoich.:	AB26C27 (1)
Weight, g/mol:	399.07515
ΔH_f, kcal/mol:	82.17
Dipole, Da:	13.56
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.945296
Charge, e:	0

Chem-info

IUPAC name:

N-[bromo(triphenyl)-lambda5-phosphanyl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC1CCC2=C(C[P+]1(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5C=C2

DOS

IR

Vibrations