Geometry & MOs

Info

ID:	199614
PubChem CID:	79271043
Reduced:	ON2C13H14 (1)
Stoich.:	AB2C13D14 (1)
Weight, g/mol:	286.189257
ΔH_f, kcal/mol:	32.17
Dipole, Da:	2.7
IP(EA), eV:	-9.21(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[cycloheptyl(methyl)carbamoyl]-(2-methoxyethyl)amino]acetic acid

Drug info:

PubChemData

Smile

C#CCNCC(=O)N1CC2=CC=CC=C2C1

DOS

IR

Vibrations