Geometry & MOs

Info

ID:	398934
PubChem CID:	135036422
Reduced:	ClSN3O3C22H24 (1)
Stoich.:	ABC3D3E22F24 (1)
Weight, g/mol:	469.221286
ΔH_f, kcal/mol:	-48.5
Dipole, Da:	7.81
IP(EA), eV:	-9.3(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2Z,4S)-4-(hydroxymethyl)-3-[(4-methoxyphenyl)methyl]-2-phenylmethoxycarbonyliminoimidazolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(C1=CC=C(C=C1)Cl)N(CC=C)C2=NS(=O)(=O)C3=CC=CC=C32

DOS

IR

Vibrations