Geometry & MOs

Info

ID:	82314
PubChem CID:	49855882
Reduced:	OF2N5H17C21 (1)
Stoich.:	AB2C5D17E21 (1)
Weight, g/mol:	421.06013
ΔH_f, kcal/mol:	-6.61
Dipole, Da:	5.63
IP(EA), eV:	-9.37(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-2-[4-(difluoromethoxy)-3,5-dimethylphenyl]-5-methylimidazol-4-amine

Drug info:

PubChemData

Smile

CC1=NC(N=C1N)(C2=CC=C(C=C2)OC(F)F)C3=CC=CC(=C3)C4=CN=CN=C4

DOS

IR

Vibrations