Geometry & MOs

Info

ID:	418334
PubChem CID:	135104217
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	325.109627
ΔH_f, kcal/mol:	-18.04
Dipole, Da:	1.98
IP(EA), eV:	-9.17(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S,4S)-4-(1,3-benzoxazol-2-ylamino)oxolan-3-yl]-N,N-dimethylmethanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2(CC2)C(=O)N3C[C@H]([C@@H](C3)O)CC4=NC=CN=C4

DOS

IR

Vibrations