Geometry & MOs

Info

ID:	220422
PubChem CID:	85189542
Reduced:	NSO6C17H23 (1)
Stoich.:	ABC6D17E23 (1)
Weight, g/mol:	369.194008
ΔH_f, kcal/mol:	-229.89
Dipole, Da:	6.35
IP(EA), eV:	-9.81(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-methyl-2-[(2-methyl-1-phenylpropoxy)carbonylamino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC1(OCC(C(O1)CC=CC(=O)OC)NS(=O)(=O)C2=CC=CC=C2)C

DOS

IR

Vibrations