Geometry & MOs

Info

ID:	415805
PubChem CID:	135088806
Reduced:	NO4C22H31 (1)
Stoich.:	AB4C22D31 (1)
Weight, g/mol:	356.097683
ΔH_f, kcal/mol:	-163.62
Dipole, Da:	5.65
IP(EA), eV:	-8.41(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1-[(3S,4S)-4-[(2-methylthieno[3,2-d]pyrimidin-4-yl)amino]oxolan-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C2CCCC2=C1)CN3CC[C@H]([C@@](C3)(CC4CC4)C(=O)O)O

DOS

IR

Vibrations