Geometry & MOs

Info

ID:	384238
PubChem CID:	134976601
Reduced:	NH17C18 (1)
Stoich.:	AB17C18 (1)
Weight, g/mol:	120.068748
ΔH_f, kcal/mol:	80.75
Dipole, Da:	2.81
IP(EA), eV:	-8.2(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-5-(dimethylamino)pent-4-en-2-ynenitrile

Drug info:

PubChemData

Smile

CC(=C(C#CC1=CC=C(C=C1)N)C2=CC=CC=C2)C

DOS

IR

Vibrations