Geometry & MOs

Info

ID:	47764
PubChem CID:	10535184
Reduced:	NO2C9H17 (1)
Stoich.:	AB2C9D17 (1)
Weight, g/mol:	171.125929
ΔH_f, kcal/mol:	-114.74
Dipole, Da:	5.45
IP(EA), eV:	-9.98(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-7-amino-5-methylhept-5-enoate

Drug info:

PubChemData

Smile

CC1(CCCCCCNC1=O)O

DOS

IR

Vibrations