Geometry & MOs

Info

ID:	155298
PubChem CID:	56352884
Reduced:	SN4O5C21H28 (1)
Stoich.:	AB4C5D21E28 (1)
Weight, g/mol:	459.182792
ΔH_f, kcal/mol:	-195.85
Dipole, Da:	9.06
IP(EA), eV:	-9.41(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[[3-[(1-phenylcyclopropanecarbonyl)amino]phenyl]sulfonylamino]ethyl]carbamate

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)NCCNC(=O)OC(C)(C)C)C

DOS

IR

Vibrations