Geometry & MOs

Info

ID:	379389
PubChem CID:	134419264
Reduced:	N2O5C22H24 (1)
Stoich.:	A2B5C22D24 (1)
Weight, g/mol:	167.1674
ΔH_f, kcal/mol:	-70.21
Dipole, Da:	4.69
IP(EA), eV:	-8.96(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,5Z)-5-propan-2-ylocta-3,5-dien-1-amine

Drug info:

PubChemData

Smile

C[C@]12CN(C[C@]1(C2COC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C)CC4=CC=CC=C4

DOS

IR

Vibrations