Geometry & MOs

Info

ID:

323973

PubChem CID:

126676700

Reduced:

N4C11H14 (2)

Stoich.:

A4B11C14 (2)

Weight, g/mol:

277.167794

ΔHf, kcal/mol:

131.02

Dipole, Da:

4.48

IP(EA), eV:

-8.15(-0.12)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

tert-butyl N-cyclopropyl-N-[[4-(hydroxymethyl)phenyl]methyl]carbamate

Drug info:

PubChemData

Smile

C1CNCCC1CC2=CC(=CC=C2)CN3C=C(C=N3)CC4=CC(=NC5=C4NNN5)N

DOS

IR

Vibrations