Geometry & MOs

Info

ID:	263356
PubChem CID:	103358844
Reduced:	ON7C12H17 (1)
Stoich.:	AB7C12D17 (1)
Weight, g/mol:	225.122575
ΔH_f, kcal/mol:	32.54
Dipole, Da:	7.2
IP(EA), eV:	-9.34(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-6-methoxy-1,3,5-triazin-2-yl)-3-methylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1(CCN(C1)C2=NC(=NC(=N2)N3C=CN=C3)NC)O

DOS

IR

Vibrations