Geometry & MOs

Info

ID:	81252
PubChem CID:	49854511
Reduced:	SN4O5C25H30 (1)
Stoich.:	AB4C5D25E30 (1)
Weight, g/mol:	491.209007
ΔH_f, kcal/mol:	-112.03
Dipole, Da:	5.19
IP(EA), eV:	-9.35(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-[[4-[(4-tert-butylphenyl)methoxy]phenyl]sulfonylamino]-N-hydroxy-2-morpholin-4-ylpropanamide

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)S(=O)(=O)NC[C@@H](C(=O)NO)N4CCCCC4

DOS

IR

Vibrations