Geometry & MOs

Info

ID:	271196
PubChem CID:	103647453
Reduced:	O2N3C18H27 (1)
Stoich.:	A2B3C18D27 (1)
Weight, g/mol:	294.205576
ΔH_f, kcal/mol:	-74.14
Dipole, Da:	4.41
IP(EA), eV:	-9.35(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-cyclopropyl-N-[3-(1H-imidazol-5-ylmethylamino)propyl]carbamate

Drug info:

PubChemData

Smile

CCN(CCCNCC1=CC(=CC=C1)C#N)C(=O)OC(C)(C)C

DOS

IR

Vibrations