Geometry & MOs

Info

ID:	290665
PubChem CID:	109817026
Reduced:	ION4C21H33 (1)
Stoich.:	ABC4D21E33 (1)
Weight, g/mol:	356.257612
ΔH_f, kcal/mol:	-25.73
Dipole, Da:	2.51
IP(EA), eV:	-9.07(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[(1-phenylcyclopentyl)methyl]-3-(1-propanoylpyrrolidin-3-yl)guanidine

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC(=NC)NCC2(CCCC2)C3=CC=CC=C3.I

DOS

IR

Vibrations