Geometry & MOs

Info

ID:	266841
PubChem CID:	103579727
Reduced:	BrN3C15H20 (1)
Stoich.:	AB3C15D20 (1)
Weight, g/mol:	308.05243
ΔH_f, kcal/mol:	26.19
Dipole, Da:	5.55
IP(EA), eV:	-8.01(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3,5-dimethylaniline

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NCC2=C(N(N=C2C)C)C

DOS

IR

Vibrations