Geometry & MOs

Info

ID:

201208

PubChem CID:

79506171

Reduced:

NOC12H21 (1)

Stoich.:

ABC12D21 (1)

Weight, g/mol:

275.152144

ΔHf, kcal/mol:

-64.57

Dipole, Da:

3.67

IP(EA), eV:

-9.61(1.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

propyl 4-(2-cyclopropylpropanoylamino)benzoate

Drug info:

PubChemData

Smile

CC(C1CC1)C(=O)NC2CCCCC2

DOS

IR

Vibrations