Geometry & MOs

Info

ID:	261404
PubChem CID:	103231091
Reduced:	NSO2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	155.094629
ΔH_f, kcal/mol:	-80.5
Dipole, Da:	7.67
IP(EA), eV:	-9.26(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-(cyclopropylmethylamino)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C=C(S1)C(=O)O)CNC2CCCC2

DOS

IR

Vibrations