Geometry & MOs

Info

ID:

295596

PubChem CID:

117535930

Reduced:

NO3C13H25 (1)

Stoich.:

AB3C13D25 (1)

Weight, g/mol:

250.168128

ΔHf, kcal/mol:

-187.5

Dipole, Da:

4.28

IP(EA), eV:

-9.89(0.98)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

benzyl N-[2-(aminomethyl)pentyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CCO)C1CCCC1

DOS

IR

Vibrations