Geometry & MOs

Info

ID:	262929
PubChem CID:	103329806
Reduced:	OSN5C14H21 (1)
Stoich.:	ABC5D14E21 (1)
Weight, g/mol:	293.131031
ΔH_f, kcal/mol:	-18.49
Dipole, Da:	7.34
IP(EA), eV:	-8.2(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]-N-tert-butylpropanamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CCNC1=C2C=CSC2=NC(=N1)NC

DOS

IR

Vibrations