Geometry & MOs

Info

ID:	249842
PubChem CID:	103092443
Reduced:	NC4H7 (3)
Stoich.:	AB4C7 (3)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	27.74
Dipole, Da:	1.9
IP(EA), eV:	-8.97(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-ethyl-4-(3-methoxy-2-propan-2-yloxyphenyl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CCCN1C(=CC=N1)/C=C/C(C)NCC

DOS

IR

Vibrations