Geometry & MOs

Info

ID:	210733
PubChem CID:	80849032
Reduced:	N5C12H17 (1)
Stoich.:	A5B12C17 (1)
Weight, g/mol:	240.169859
ΔH_f, kcal/mol:	45.73
Dipole, Da:	2.89
IP(EA), eV:	-8.01(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-3-methylbutan-1-ol

Drug info:

PubChemData

Smile

CC1CN(CC1C)C2=NC(=CN3C2=NC=C3)N

DOS

IR

Vibrations