Geometry & MOs

Info

ID:	199665
PubChem CID:	79279520
Reduced:	ON2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	266.126657
ΔH_f, kcal/mol:	-33.9
Dipole, Da:	3.95
IP(EA), eV:	-9.25(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(2-methylcyclopropanecarbonyl)amino]propanoyl-prop-2-ynylamino]acetic acid

Drug info:

PubChemData

Smile

CCC(CC1CC1)NC(=O)CNCC=C

DOS

IR

Vibrations