Geometry & MOs

Info

ID:	143618
PubChem CID:	53235785
Reduced:	ClON3C21H24 (1)
Stoich.:	ABC3D21E24 (1)
Weight, g/mol:	268.14633
ΔH_f, kcal/mol:	4.73
Dipole, Da:	4.41
IP(EA), eV:	-9.39(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,2-dimethyl-3,3-diphenylpropanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)N2C=[N+]3[C@H](COCC3=N2)CC4=CC=CC=C4)C.[Cl-]

DOS

IR

Vibrations