Geometry & MOs

Info

ID:	212712
PubChem CID:	81061589
Reduced:	BrON2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	299.17644
ΔH_f, kcal/mol:	-19.32
Dipole, Da:	5.06
IP(EA), eV:	-8.48(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-6-chloro-N,5-dimethyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCCN(C)C1=NC(=CC=C1)Br

DOS

IR

Vibrations