Geometry & MOs

Info

ID:	379237
PubChem CID:	134356883
Reduced:	IN2C6H11 (1)
Stoich.:	AB2C6D11 (1)
Weight, g/mol:	165.115364
ΔH_f, kcal/mol:	28.67
Dipole, Da:	0.52
IP(EA), eV:	-8.8(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3E,5Z)-hepta-1,3,5-trien-3-yl]propanamide

Drug info:

PubChemData

Smile

C1CN(CC12CNC2)I

DOS

IR

Vibrations