Geometry & MOs

Info

ID:	70570
PubChem CID:	48413527
Reduced:	ON5C18H27 (1)
Stoich.:	AB5C18D27 (1)
Weight, g/mol:	388.229683
ΔH_f, kcal/mol:	11.26
Dipole, Da:	4.17
IP(EA), eV:	-8.79(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[5-(diethylamino)pentan-2-yl]-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=CN=C(C=C1)N2C=CC=N2

DOS

IR

Vibrations