Geometry & MOs

Info

ID:	249891
PubChem CID:	103092688
Reduced:	SN2O2C11H16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	169.18305
ΔH_f, kcal/mol:	19.61
Dipole, Da:	5.79
IP(EA), eV:	-9.23(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5,5-dimethyl-N-propylhex-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C=C/C1=CSC(=C1)[N+](=O)[O-]

DOS

IR

Vibrations