Geometry & MOs

Info

ID:	34058
PubChem CID:	7889635
Reduced:	SN3O4H15C17 (1)
Stoich.:	AB3C4D15E17 (1)
Weight, g/mol:	353.199094
ΔH_f, kcal/mol:	-99.56
Dipole, Da:	6.2
IP(EA), eV:	-9.1(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-tert-butyl-2,6-dimethylphenyl)methyl 2-benzamidoacetate

Drug info:

PubChemData

Smile

CC1=CSC2=NC(=CC(=O)N12)COC(=O)CNC(=O)C3=CC=CC=C3

DOS

IR

Vibrations