Geometry & MOs

Info

ID:	81534
PubChem CID:	49854836
Reduced:	N3O4C19H19 (1)
Stoich.:	A3B4C19D19 (1)
Weight, g/mol:	512.209341
ΔH_f, kcal/mol:	-57.15
Dipole, Da:	6.04
IP(EA), eV:	-8.46(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-hydroxy-3-[propyl-[4-(quinolin-4-ylmethoxy)phenyl]sulfonylamino]-2-pyrrolidin-1-ylpropanamide

Drug info:

PubChemData

Smile

COC1=C/C(=C\NNC(=O)CCOC2=CC3=C(C=C2)NC=C3)/C(=O)C=C1

DOS

IR

Vibrations