Geometry & MOs

Info

ID:	289268
PubChem CID:	104342644
Reduced:	OSN4C12H16 (1)
Stoich.:	ABC4D12E16 (1)
Weight, g/mol:	306.151433
ΔH_f, kcal/mol:	18.23
Dipole, Da:	3.53
IP(EA), eV:	-8.35(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxymethyl)-4-N,6-N-dimethyl-4-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCNC1=CC(=NC(=N1)COC)NC2=CSC=C2

DOS

IR

Vibrations