Geometry & MOs

Info

ID:	423949
PubChem CID:	135120832
Reduced:	N3O4C19H23 (1)
Stoich.:	A3B4C19D23 (1)
Weight, g/mol:	327.125277
ΔH_f, kcal/mol:	-76.22
Dipole, Da:	6.42
IP(EA), eV:	-8.39(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(methanesulfonamido)-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)N2CCC3=C(C2)C(=NN3)C4CC4)OC)OC

DOS

IR

Vibrations