Geometry & MOs

Info

ID:	251493
PubChem CID:	103104363
Reduced:	ON7C12H23 (1)
Stoich.:	AB7C12D23 (1)
Weight, g/mol:	223.14331
ΔH_f, kcal/mol:	-21.17
Dipole, Da:	4.77
IP(EA), eV:	-9.14(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethyl-[2-(ethylamino)pyrimidin-4-yl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C1=NC(=NC(=N1)NC)N(CC)CC(=O)N

DOS

IR

Vibrations