Geometry & MOs

Info

ID:	380456
PubChem CID:	134970907
Reduced:	NOC21H23 (1)
Stoich.:	ABC21D23 (1)
Weight, g/mol:	306.127623
ΔH_f, kcal/mol:	35.95
Dipole, Da:	2.62
IP(EA), eV:	-9.22(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@@H](C(C1=CC=CC=C1)(C2=CC=CC=C2)O)NCC3C=CC=C3

DOS

IR

Vibrations