Geometry & MOs

Info

ID:	265040
PubChem CID:	103507441
Reduced:	O2S2N3C12H19 (1)
Stoich.:	A2B2C3D12E19 (1)
Weight, g/mol:	311.130363
ΔH_f, kcal/mol:	-70.15
Dipole, Da:	2.97
IP(EA), eV:	-8.24(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-5-propanoylthiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCS1)C2=C(C(=C(S2)C(=O)NC)N)OC

DOS

IR

Vibrations