Geometry & MOs

Info

ID:	343737
PubChem CID:	127266913
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	330.180424
ΔH_f, kcal/mol:	-168.86
Dipole, Da:	1.54
IP(EA), eV:	-9.33(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylamino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

COC(=O)C(CC1=CC=CC=C1)NCCOC2CCCCO2

DOS

IR

Vibrations