Geometry & MOs

Info

ID:	249741
PubChem CID:	103091716
Reduced:	SN3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	155.131014
ΔH_f, kcal/mol:	39.66
Dipole, Da:	5.99
IP(EA), eV:	-8.36(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-(oxolan-3-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=CN2C(=C(N=C2S1)C)C=C(C)C(C)N

DOS

IR

Vibrations