Geometry & MOs

Info

ID:	420878
PubChem CID:	135114980
Reduced:	N2S2O5C15H24 (1)
Stoich.:	A2B2C5D15E24 (1)
Weight, g/mol:	263.163377
ΔH_f, kcal/mol:	-198.81
Dipole, Da:	2.63
IP(EA), eV:	-9.77(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)N[C@@H]2COC[C@H]2CS(=O)(=O)N(C)C)C

DOS

IR

Vibrations