Geometry & MOs

Info

ID:	33231
PubChem CID:	7885536
Reduced:	NO3F5H14C18 (1)
Stoich.:	AB3C5D14E18 (1)
Weight, g/mol:	277.088498
ΔH_f, kcal/mol:	-312.29
Dipole, Da:	5.25
IP(EA), eV:	-9.58(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C(=C(C(=C2F)F)F)F)F)C

DOS

IR

Vibrations