Geometry & MOs

Info

ID:	414903
PubChem CID:	135087875
Reduced:	NSO5C16H23 (1)
Stoich.:	ABC5D16E23 (1)
Weight, g/mol:	342.194343
ΔH_f, kcal/mol:	-214.71
Dipole, Da:	3.59
IP(EA), eV:	-9.6(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-2-methyl-N-[(3R,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]propanamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)N1CC[C@]([C@H](C1)O)(CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations