Geometry & MOs

Info

ID:	249948
PubChem CID:	103093054
Reduced:	NSC14H23 (1)
Stoich.:	ABC14D23 (1)
Weight, g/mol:	311.08848
ΔH_f, kcal/mol:	-2.11
Dipole, Da:	2.2
IP(EA), eV:	-8.75(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-(5-bromo-2-propoxyphenyl)-N,3-dimethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C(=C/C1=CC=C(S1)C(C)(C)C)/C)NC

DOS

IR

Vibrations