Geometry & MOs

Info

ID:	213151
PubChem CID:	81063036
Reduced:	N3O4C14H21 (1)
Stoich.:	A3B4C14D21 (1)
Weight, g/mol:	308.167083
ΔH_f, kcal/mol:	-82.73
Dipole, Da:	8.0
IP(EA), eV:	-9.17(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=C(C=CC(=C1)NC)[N+](=O)[O-]

DOS

IR

Vibrations