Geometry & MOs

Info

ID:	148622
PubChem CID:	53788290
Reduced:	NPO4C17H20 (1)
Stoich.:	ABC4D17E20 (1)
Weight, g/mol:	237.094696
ΔH_f, kcal/mol:	-183.14
Dipole, Da:	3.01
IP(EA), eV:	-9.5(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CP(=O)([C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)O

DOS

IR

Vibrations