Geometry & MOs

Info

ID:	289208
PubChem CID:	104340259
Reduced:	O2N5C14H25 (1)
Stoich.:	A2B5C14D25 (1)
Weight, g/mol:	266.174276
ΔH_f, kcal/mol:	-63.63
Dipole, Da:	2.82
IP(EA), eV:	-8.85(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cyclopropyl-2-(ethoxymethyl)-4-N-(2-methoxyethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCN(CC(=O)N(C)C)C1=NC(=NC(=C1)NC)COCC

DOS

IR

Vibrations