Geometry & MOs

Info

ID:	377812
PubChem CID:	134223877
Reduced:	NO5C25H31 (1)
Stoich.:	AB5C25D31 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	-189.93
Dipole, Da:	12.5
IP(EA), eV:	-8.63(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-ethenyl-N,2-dimethyl-5-methylideneheptan-3-amine

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)OC)OC4CCCC4)C(C)C

DOS

IR

Vibrations