Geometry & MOs

Info

ID:	263021
PubChem CID:	103334128
Reduced:	S2N5C13H13 (1)
Stoich.:	A2B5C13D13 (1)
Weight, g/mol:	299.120467
ΔH_f, kcal/mol:	93.74
Dipole, Da:	2.61
IP(EA), eV:	-8.39(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydrazinyl-N-(3-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC2=C(C=C(S2)C)C(=N1)SC3=NC=CC=N3

DOS

IR

Vibrations