Geometry & MOs

Info

ID:	403492
PubChem CID:	135060570
Reduced:	O2N3H29C34 (1)
Stoich.:	A2B3C29D34 (1)
Weight, g/mol:	120.070578
ΔH_f, kcal/mol:	50.61
Dipole, Da:	6.45
IP(EA), eV:	-8.42(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-chloro-2,2-dimethylbutane

Drug info:

PubChemData

Smile

CC1=C2C(=C(C(=N1)C(=O)NCC3=CC=CC=C3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C6=CC=CC=C6N2C

DOS

IR

Vibrations