Geometry & MOs

Info

ID:	445356
PubChem CID:	135266438
Reduced:	NOC9H9 (3)
Stoich.:	ABC9D9 (3)
Weight, g/mol:	182.141913
ΔH_f, kcal/mol:	-10.19
Dipole, Da:	4.84
IP(EA), eV:	-8.74(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-3-methanimidoyl-2-methylhex-3-en-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)C(CN)C2=CC=C(C=C2)OCC(=O)C3=CC=CC=C3)C=NC=C

DOS

IR

Vibrations