Geometry & MOs

Info

ID:	263032
PubChem CID:	103335269
Reduced:	S2N3C16H17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	304.147016
ΔH_f, kcal/mol:	60.74
Dipole, Da:	3.67
IP(EA), eV:	-8.43(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)CSC2=NC(=NC3=C2C=CS3)NC)C

DOS

IR

Vibrations