Geometry & MOs

Info

ID:	288671
PubChem CID:	104323255
Reduced:	N3O3C13H23 (1)
Stoich.:	A3B3C13D23 (1)
Weight, g/mol:	278.185509
ΔH_f, kcal/mol:	-164.92
Dipole, Da:	2.17
IP(EA), eV:	-9.5(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol

Drug info:

PubChemData

Smile

CCNC(=O)NC(=O)C(C)N1CC2CCC(C2C1)O

DOS

IR

Vibrations