Geometry & MOs

Info

ID:	443289
PubChem CID:	135258419
Reduced:	Cl3N4O5H29C30 (1)
Stoich.:	A3B4C5D29E30 (1)
Weight, g/mol:	155.131014
ΔH_f, kcal/mol:	-39.77
Dipole, Da:	2.87
IP(EA), eV:	-9.24(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-ethyl-3-prop-1-en-2-yloxybut-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)N=C(/C=C(/C(=O)OC)\N)C1=NOC(C1)C2=C(C=C(C=C2)OCC3=C(ON=C3C4=C(C=CC=C4Cl)Cl)C5CC5)Cl

DOS

IR

Vibrations