Geometry & MOs

Info

ID:	218525
PubChem CID:	85089572
Reduced:	N4O5C25H40 (1)
Stoich.:	A4B5C25D40 (1)
Weight, g/mol:	476.278741
ΔH_f, kcal/mol:	-236.97
Dipole, Da:	4.84
IP(EA), eV:	-8.61(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylcyclohexyl) N-[1-[(2-amino-2-phenylethyl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NCCCC(=O)NCCCN1CCOCC1)NC(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations