Geometry & MOs

Info

ID:	340690
PubChem CID:	127262701
Reduced:	NPC27H27 (1)
Stoich.:	ABC27D27 (1)
Weight, g/mol:	343.242887
ΔH_f, kcal/mol:	95.79
Dipole, Da:	6.63
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.932392
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-N,N-dicyclohexyl-1-phenylphospholan-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC=C1[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations