Geometry & MOs

Info

ID:	222537
PubChem CID:	85305480
Reduced:	NO4C22H23 (1)
Stoich.:	AB4C22D23 (1)
Weight, g/mol:	365.220223
ΔH_f, kcal/mol:	-89.3
Dipole, Da:	6.59
IP(EA), eV:	-8.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-hydroxy-2,4,4-trimethyl-2-(phenylmethoxycarbonylamino)pentanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2=CC(=CC3=CC(=C(C(=C3)OC)OC)OC)C(=O)N2)C

DOS

IR

Vibrations