Geometry & MOs

Info

ID:	403725
PubChem CID:	135061510
Reduced:	N3O7C30H41 (1)
Stoich.:	A3B7C30D41 (1)
Weight, g/mol:	492.09126
ΔH_f, kcal/mol:	-306.08
Dipole, Da:	2.21
IP(EA), eV:	-9.46(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (4S)-3,3-bis(benzenesulfonyl)-4-ethenylcyclopentane-1,1-dicarboxylate

Drug info:

PubChemData

Smile

CC1(CC=CCC2=C3CN(CC3=CC=C2)C(=O)O[C@@H]4C[C@H](N(C4)C(=O)[C@@H](NC(=O)OC1)C(C)(C)C)C(=O)OC)C

DOS

IR

Vibrations