Geometry & MOs

Info

ID:	390993
PubChem CID:	135002081
Reduced:	ClNO2C19H20 (1)
Stoich.:	ABC2D19E20 (1)
Weight, g/mol:	363.11978
ΔH_f, kcal/mol:	-34.0
Dipole, Da:	2.85
IP(EA), eV:	-9.07(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromophenyl)-4-methoxy-N-(2,4,4-trimethylpentan-2-yl)but-2-yn-1-imine

Drug info:

PubChemData

Smile

CC(C)(C)N=C1C2=CC=CC=C2C(O1)(CCl)OC3=CC=CC=C3

DOS

IR

Vibrations