Geometry & MOs

Info

ID:	44769
PubChem CID:	10505848
Reduced:	N3O7C27H31 (1)
Stoich.:	A3B7C27D31 (1)
Weight, g/mol:	509.256609
ΔH_f, kcal/mol:	-262.74
Dipole, Da:	2.72
IP(EA), eV:	-9.65(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R,5S)-N-benzyl-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-amine

Drug info:

PubChemData

Smile

COC(=O)CCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2CN(CCC2=O)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations